SCHEMBL7072268

SCHEMBL7072268

CCCCCCCCCCOc1c(COc2ccccc2CC(OCC)C(=O)O)cnc2ccc(C)cc12

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.37
PPARA Q07869 8/20 0.37
PPARD Q03181 3/20 0.37
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 2/20 0.36
ATM Q13315 1/20 0.35
TP53 P04637 1/20 0.35
PTGES O14684 1/20 0.35
ALOX5 P09917 1/20 0.35
POLB P06746 1/20 0.35
SGMS2 Q8NHU3 2/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7067231 0.90 PLA2G2A (0.40) PPARGPPARAPPARDMAPTSMN1; SMN2
SCHEMBL7067412 0.90 PLA2G2A (0.40) PPARGPPARAPPARDMAPTSMN1; SMN2
SCHEMBL7070148 0.87 MAPT (0.38) PPARGPPARAPPARDMAPTSMN1; SMN2
SCHEMBL7072265 0.86 PPARA (0.51) PPARGPPARAPPARD
SCHEMBL7067408 0.85 MAPT (0.41) MAPTSMN1; SMN2ALDH1A1TP53
SCHEMBL7069897 0.84 MAPT (0.40) PPARGPPARAPPARDMAPTSMN1; SMN2
SCHEMBL7066803 0.81 MAPT (0.42) PPARGPPARAPPARDMAPTSMN1; SMN2
SCHEMBL7070113 0.79 PPARG (0.40) PPARGPPARAPPARDMAPTALDH1A1
SCHEMBL7066084 0.78 NUDT1 (0.41) PPARGPPARAPPARDMAPT
SCHEMBL7066784 0.78 PPARA (0.39) PPARGPPARAPPARD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030212100-A1 Quinoline derivatives and medicinal use thereof MITSUI CHEMICALS, INC. (JP) 2003-11-13 US disclosed
EP-1266888-A1 QUINOLINE DERIVATIVES AND MEDICINAL USE THEREOF Mitsui Chemicals, Inc. (JP) 2002-12-18 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030212100-A1 Quinoline derivatives and medicinal use thereof PPARG, PPARD, PPARA PPARG 1/4885PPARA 3/4885PPARD 2/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.